N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine

C15H33N3 — CID 55094563

IUPACN'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
SMILESCCCN(CCN(C)C)CC1CCCC1NCC
InChIInChI=1S/C15H33N3/c1-5-10-18(12-11-17(3)4)13-14-8-7-9-15(14)16-6-2/h14-16H,5-13H2,1-4H3
InChIKeyARHARRJZKVUVNX-UHFFFAOYSA-N
MW255.45 g/mol
LogP2.04
Rot. Bonds9

About N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine

N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine (PubChem CID 55094563) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine.

Molecular Properties

Compound NameN'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
PubChem CID55094563
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC NameN'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
SMILESCCCN(CCN(C)C)CC1CCCC1NCC
InChIInChI=1S/C15H33N3/c1-5-10-18(12-11-17(3)4)13-14-8-7-9-15(14)16-6-2/h14-16H,5-13H2,1-4H3
InChIKeyARHARRJZKVUVNX-UHFFFAOYSA-N
XLogP2.04
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-[[2-(ethylamino)cycloheptyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 62611047
N-ethyl-2-[[propyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-amine
CID 62610305
2-[[cyclopropyl(propyl)amino]methyl]-N-ethylcyclopentan-1-amine
CID 62615562
2-[[bis(3-methylbutyl)amino]methyl]-N-ethylcyclohexan-1-amine
CID 107871148
2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethylcyclopentan-1-amine
CID 63631296
N'-[(2-aminocycloheptyl)methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 62611045
2-[[cyclobutylmethyl(ethyl)amino]methyl]-N-ethylcyclohexan-1-amine
CID 107401671
N-ethyl-2-[[methyl(pentan-3-yl)amino]methyl]cyclopentan-1-amine
CID 62616438
N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine
CID 62614429
2-[[cyclopropyl(methyl)amino]methyl]-N-ethylcyclohexan-1-amine
CID 62616008
trans-(1R,2S)-N-ethyl-2-propylcyclopentan-1-amine
CID 11665449
N-ethyl-2-[[methyl(3-methylbutyl)amino]methyl]cycloheptan-1-amine
CID 62610199

Frequently Asked Questions

What is the IUPAC name of N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine?
The IUPAC name of N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine (CID 55094563) is N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine.
What is the SMILES notation for N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine?
The canonical SMILES for N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine is CCCN(CCN(C)C)CC1CCCC1NCC.
What is the InChIKey of N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine?
The InChIKey is ARHARRJZKVUVNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-5-10-18(12-11-17(3)4)13-14-8-7-9-15(14)16-6-2/h14-16H,5-13H2,1-4H3.
What are the key properties of N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine?
N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine has a molecular weight of 255.45 g/mol, XLogP of 2.04, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[[2-(ethylamino)cyclopentyl]methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine is sourced from PubChem (CID 55094563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).